2-methoxy-N-(4-oxidanylidene-2-pyrimidin-4-yl-7,8,9,10-tetrahydro-6H-pyrimido[1,2-a]azepin-10-yl)pyridine-3-carboxamide

Systemtic Name: 2-methoxy-N-(4-oxidanylidene-2-pyrimidin-4-yl-7,8,9,10-tetrahydro-6H-pyrimido[1,2-a]azepin-10-yl)pyridine-3-carboxamide Openeye Name: 2-methoxy-N-(4-oxo-2-pyrimidin-4-yl-7,8,9,10-tetrahydro-6H-pyrimido[1,2-a]azepin-10-yl)pyridine-3-carboxamide CAS Name: 2-methoxy-N-[4-oxo-2-(4-pyrimidinyl)-7,8,9,10-tetrahydro-6H-pyrimido[1,2-a]azepin-10-yl]-3-pyridinecarboxamide IUPAC Name: 2-methoxy-N-(4-oxo-2-pyrimidin-4-yl-7,8,9,10-tetrahydro-6H-pyrimido[1,2-a]azepin-10-yl)pyridine-3-carboxamide Traditional Name: N-[4-keto-2-(4-pyrimidyl)-7,8,9,10-tetrahydro-6H-pyrimid[1,2-a]azepin-10-yl]-2-methoxy-nicotinamide Formula: C20H20N6O3 MolecularWeight: 392.4112

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC=N1)C(=O)NC2CCCCN3C2=NC(=CC3=O)C4=NC=NC=C4

Isomeric SMILES

COC1=C(C=CC=N1)C(=O)NC2CCCCN3C2=NC(=CC3=O)C4=NC=NC=C4

InChI

InChI=1S/C20H20N6O3/c1-29-20-13(5-4-8-22-20)19(28)25-15-6-2-3-10-26-17(27)11-16(24-18(15)26)14-7-9-21-12-23-14/h4-5,7-9,11-12,15H,2-3,6,10H2,1H3,(H,25,28)